SCHEMBL7262114

SCHEMBL7262114

c1cn(Nn2ccnc2)cn1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.41
QPCT Q16769 1/20 0.41
HSD17B10 Q99714 1/20 0.41
QPCTL Q9NXS2 1/20 0.41
TBXAS1 P24557 1/20 0.35
CYP3A4 P08684 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP11B1 P15538 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
ENPP2 Q13822 1/20 0.30
MKNK1 Q9BUB5 1/20 0.30
MKNK2 Q9HBH9 1/20 0.30
HTT P42858 1/20 0.30
NOTUM Q6P988 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2840229 0.77
SCHEMBL2840228 0.77
SCHEMBL28486037 0.77
SCHEMBL16542717 0.77
SCHEMBL5087445 0.77
SCHEMBL28663405 0.77 CYP2B6 (0.32) NFKB1QPCTHSD17B10QPCTLCYP3A4
Hydrochloric Acid SCHEMBL28847875 0.75
Pyrazine SCHEMBL28047911 0.73 QPCT (0.40) NFKB1QPCTHSD17B10QPCTLTBXAS1
SCHEMBL3277667 0.71
SCHEMBL3314432 0.71

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1288309-A1 Methods for labeling L-nucleic acids Noxxon Pharma AG (DE) 2003-03-05 EP disclosed